1-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-4-(3-methylphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-4-(3-methylphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-4-(3-methylphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J081-2412 |
| Compound Name: | 1-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-4-(3-methylphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 404.49 |
| Molecular Formula: | C22 H20 N4 O2 S |
| Smiles: | Cc1cccc(c1)C1CC(Nc2c1c(C)nn2c1nc2ccc(cc2s1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.652 |
| logD: | 4.5694 |
| logSw: | -4.5021 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.17 |
| InChI Key: | NUIQPYOVLZWCBJ-INIZCTEOSA-N |